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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.
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Cosmological fluids with logarithmic equation of state
We investigate the cosmological applications of fluids having an equation of state which is the analog to the one related to the isotropic deformation of crystalline solids, that is containing logarithmic terms of the energy density, allowing additionally for a bulk viscosity. We consider two classes of scenarios and we show that they are both capable of triggering the transition from deceleration to acceleration at late times. Furthermore, we confront the scenarios with data from Supernovae type Ia (SN Ia) and Hubble function observations, showing that the agreement is excellent. Moreover, we perform a dynamical system analysis and we show that there exist asymptotic accelerating attractors, arisen from the logarithmic terms as well as from the viscosity, which in most cases correspond to a phantom late-time evolution. Finally, for some parameter regions we obtain a nearly de Sitter late-time attractor, which is a significant capability of the scenario since the dark energy, although dynamical, stabilizes at the cosmological constant value.
Electronic hydrodynamics in graphene
Highlights: Electrons in ultra-clean graphene at high enough temperatures behave hydrodynamically. Unconventional hydrodynamics in graphene can be derived from the kinetic theory. Kinetic coefficients include the quantum conductivity and shear and Hall viscosities. -- Abstract: In this paper I report a pedagogical derivation of the unconventional electronic hydrodynamics in graphene on the basis of the kinetic theory. While formally valid in the weak coupling limit, this approach allows one to derive the unconventional hydrodynamics in the system which is neither Galilean- nor Lorentz-invariant, such that hydrodynamic equations cannot be inferred from symmetry arguments. I generalize earlier work to include external magnetic fields and give explicit expressions for dissipative coefficients, the shear viscosity and electrical conductivity. I also compare the resulting theory with relativistic hydrodynamics.
Twin-screw granulation: Mechanistic understanding of the effect of material properties on key granule quality attributes through the analysis of mixing dynamics and granulation rate mechanisms
This study focuses on understanding the effect of material properties on granule quality attributes through the analysis of mixing dynamics and granulation rate mechanisms. Powder wettability, binder viscosity, and liquid-to-solid (L/S) ratio were the factors that were investigated in this study. Further, the mixing occurring inside the twin-screw granulator (TSG) was quantitatively assessed by obtaining the axial dispersion coefficient from the experimentally measured residence time distribution (RTD) curves. It was observed that the quality of the nuclei fed to the kneading zone significantly affected the mixing dynamics. The quality of nuclei was governed by nucleation kinetics, which in turn was principally affected by the liquid saturation of the nuclei and the ratio of drop penetration time and encounter time, which in turn were affected by the L/S ratio and binder viscosity respectively. The hydrophobicity of the blend mainly affected the extent of nucleation. The type of nuclei entering the kneading zone and mixing dynamics in the TSG also determined whether the granulation growth mechanism was “layering-dominant” or “viscous-dominant”. It was also shown that the resultant granule quality attributes were a reflection of the growth mechanisms. Ultimately, a mechanistic link between material properties, mixing dynamics, granulation rate mechanisms, and granule quality attributes was established.
Microscopic relaxations in a protein sustained down to 160 K in a non-glass forming organic solvent
In this paper, we have studied microscopic dynamics of a protein in carbon disulfide, a non-glass forming solvent, down to its freezing temperature of ca. 160 K. We have utilized quasielastic neutron scattering. A comparison of lysozyme hydrated with water and dissolved in carbon disulfide reveals a stark difference in the temperature dependence of the protein's microscopic relaxation dynamics induced by the solvent. In the case of hydration water, the common protein glass-forming solvent, the protein relaxation slows down in response to a large increase in the water viscosity on cooling down, exhibiting a well-known protein dynamical transition. The dynamical transition disappears in non-glass forming carbon disulfide, whose viscosity remains a weak function of temperature all the way down to freezing at just below 160 K. The microscopic relaxation dynamics of lysozyme dissolved in carbon disulfide is sustained down to the freezing temperature of its solvent at a rate similar to that measured at ambient temperature. Finally, our results demonstrate that protein dynamical transition is not merely solvent-assisted, but rather solvent-induced, or, more precisely, is a reflection of the temperature dependence of the solvent's glass-forming dynamics.
Alleviation of A disintegrin and metalloprotease 10 (ADAM10) on thromboangiitis obliterans involves the HMGB1/RAGE/ NF-κB pathway
Highlights: • TAO rats displayed higher whole blood viscosity and blood platelet count. • TAO rats had structural damages of vascular smooth muscle and endothelial cells. • ADAM treatment alleviated the symptoms of TAO rats in a dose-dependent pattern. • HMGB1, RAGE and NF-κB increased in TAO rats in both mRNA and protein level. • HMGB1, RAGE and NF-κB decreased by ADAM10 treatment in both mRNA and protein level. Thromboangiitis obliterans (TAO), also known as Buerger's disease, is a nonatherosclerotic inflammatory disease that influences medium- and small-sized blood vessels of extremities. However, mechanisms underlying TAO are still unclear. As a mediator associated with inflammation, A disintegrin and metalloprotease 10 (ADAM10) was hypothesized to play inhibitory roles in the development of TAO. Thus, the objective of this study is to investigate the effects of ADAM10 in a sodium laurate-induced TAO rat model and elucidate underlying mechanisms. Male Wistar rats were randomly divided into four groups (n = 6) for treatment: sham-operated (SHAM), TAO model (TAO), ADAM10 low dose injection (3 mg/kg; ADAM10-LD) and ADAM10 high dose injection (6 mg/kg; ADAM10-HD). After 14-day treatment, color Doppler ultrasound and hematology analysis indicated TAO rats displayed higher whole blood viscosity and blood platelet count compared with those in the SHAM group. Histologic evaluation and transmission electron microscopy revealed that the ultrastructural damages of vascular smooth muscle and endothelial cells were observed in TAO rats, such as fractured endoplasmic reticulum, decreased cell counts, and fibrillation. On the other hand, the typical signs and symptoms of TAO rats were significantly alleviated via ADAM10 treatment with a dose-dependent pattern. Real-time PCR and western blot results revealed that the expression of high-mobility-group box 1 (HMGB1), receptor for advanced glycation end-products (RAGE) and nuclear factor-kappa B (NF-κB) increased in TAO rats whereas decreased by ADAM10 treatment in both mRNA and protein levels. In conclusion, the results suggest ADAM10 alleviates symptoms of sodium laurate-induced TAO in rats via the RAGE/NF-κB signaling pathway and provides insight into the molecular basis and a potential therapeutic strategy for TAO.
Green co-solvent-assisted one-pot synthesis of high-performance flexible lignin polyurethane foam
Although lignin is a promising candidate as a source of polyol for producing eco-friendly polyurethane foam (PUF), its direct application has limitations, primarily stemming from the brittleness of the resulting products and poor processibility at high lignin loadings. To address these technical challenges, we introduced an effective co-solvent for the lignin-based polyurethane foams (LPUFs) with up to 80wt% of lignin substitution for petroleum polyols. As a green co-solvent that involves carbon dioxide fixation during its production, propylene carbonate (PC), was blended with lignin and improved the distribution of lignin by decreasing the viscosity, providing a room-temperature reaction. The LPUFs demonstrated a comparable thermal insulation performance (R-values greater than 5 in -1 ) with commercially available PUF with a uniform size of closed-cell structure induced by the reduced viscosity of lignin-based polyol. LPUFs also showed enhanced fire retardancy and moisture resistance compared to the control PUFs, benefiting from lignin’s intrinsic fire-resistant and hydrophobic properties. To mitigate the brittleness issue at high lignin loadings, flexible polyethylene glycols (PEGs) with a high molecular weight (i.e., PEG-1000) were dissolved in PC at room temperature to further improve the mechanical strength of LPUFs. The compressive strength of LPUFs with 80 wt% lignin substitution content was remarkably improved to 226 kPa by the employment of co-solvent and PEG-1000 compared to the control PUF (<140 kPa). Moreover, the flexibility of the LPUFs was successfully controlled by simply adjusting the PEG-400/PEG-1000 ratio. In conclusion, the results of this study provide valuable insights for accelerating and broadening the utilization of lignin in sustainable materials and manufacturing areas.
Comparison of unique effects of two contrasting types of cellulose nanomaterials on setting time, rheology, and compressive strength of cement paste
Not Available
Material processing, microstructure, and composite properties of low carbon Engineered Cementitious Composites (ECC)
Traditional PVA fiber-reinforced Engineered Cementitious Composites (ECC) show high tensile ductility and superior durability with tight crack width, but the high cost and embodied carbon can hinder its wider application in infrastructures. The objective of this study is to develop a better understanding of the fresh and hardened properties of an ECC that employs a lower embodied-carbon binder, Limestone Calcined Clay Cement (LC3), and lower-cost PP fiber that is widely available. Specifically, the interrelations between material processing, microstructure, and composite properties were studied experimentally. The results showed that ECC with high tensile ductility up to 9% tensile strain and tight crack width with 50 μm at 2% tensile strain can be achieved. It was found that a matrix paste with higher viscosity generally enhanced fiber dispersion uniformity and robustness in tensile strain-hardening. The paste viscosity is increased when OPC is replaced by LC3 and can be tuned with superplasticizer content. Larger maximum flaw size leads to lower first crack strength, beneficial for microcrack initiation and multiple cracking. This study generates fundamental knowledge linking processing-microstructure-performance of PP-LC3-ECC. This class of low embodied carbon ECC with tight crack width is expected to contribute to reducing the carbon footprint of the built environment.
Calcining natural zeolites to improve their effect on cementitious mixture workability
Despite the benefits to long-term concrete durability, the use of natural zeolites as supplementary cementitious materials (SCMs) is uncommon due to their high water demand. The motivation of the research presented here was to better understand how the physical and chemical characteristics of natural zeolites influenced the workability of cementitious mixtures and whether those properties could be modified through calcination to mitigate the high water demand of natural zeolites. In this research, three different natural zeolites were characterized in their original and calcined states using x-ray diffraction (XRD) and Brunauer–Emmett–Teller (BET) surface area measurements. Rheology experiments were then conducted on cementitious pastes containing these natural zeolites, in their original and calcined states, to assess mixture viscosity and yield stress. Results showed that calcination destabilized the structure of the natural zeolites and reduced their surface area, which led to an improvement in mixture viscosity and yield stress.
Rheology of fresh cement pastes containing polymer nanoparticles
Influences of polymer nanoparticles (PNPs) with varied charge densities on the rheological behaviors of fresh cement pastes (fcps) without and with polycarboxylate superplasticizer (PCE) were studied. In the blank fcp, the addition of PCE and highly anionically charged PNPs greatly decreases the yield stress and the plastic viscosity due to their large adsorption on cement that produces electrostatic repulsion and steric hindrance between cement grains. However, the non-adsorbing nonionic PNPs show a slightly opposite effect. In the PCE-containing fcp, both the anionic and nonionic PNPs become non-adsorbing on cement due to the stronger affinity of PCE to cement surface. In this way, the addition of the PNPs in the PCE-containing fcp slightly increases the yield stress and the plastic viscosity, but significantly decreases the pseudoplastic index, which is believed to result from the generation of the so-called depletion attractive force between cement grains induced by the non-adsorbing polymers.
Three-dimensional simulation of rivulet and film flows over an inclined plate: Effects of solvent properties and contact angle
This is the paper we drafted based on CCSI Task 3 work on wetted area prediction with volume of fluids method.
Slurry rheology of Hanford sludge
Here we evaluate the slurry viscosity of radioactive waste. Hanford waste is a motely mixture of particle sizes and densities composed of metal and oxide particles with constituents spanning much of the periodic table stored at high ionic strength and high pH. Hanford wastes have traditionally been represented as simply an ideal Bingham plastic, but this rheological approximation often provides a poor fit from 0 to 200 1/s, precisely the range of interest for engineering design of waste transport and mixing systems. Here we use a modified Cross formulation inclusive of a yield stress to fit stress-strain rate data for reconstituted Hanford REDOX sludge waste, measured by increasing shear-rate (up-ramp) and decreasing shear-rate (down-ramp) sweeps. We find that this continuous single equation formulation quantitatively matches experimental data better than other rheological models including the Bingham plastic and Herschel-Bulkley approximations. The increase of viscosity and yield stress from up ramp to down ramp indicates the formation of particle microstructure during shear due to attractive forces.
Laminar drag reduction in microchannels with liquid infused textured surfaces
Liquid infused surfaces (LIS) achieve non-wetting properties through asperity structures containing pockets of a lubricating liquid rather than air. Although studies have demonstrated several potential applications of LIS, the effect of liquid infused texture on the flow of liquid in microchannels has not been systematically addressed. The present work focuses on the effect of liquid-infused texture geometry and the infused liquid properties on the flow characteristics of a bulk fluid in rectangular and round microchannel geometries. Considering four different textured geometries of transverse ridges, longitudinal ridges, in-lined square posts and staggered squares, a detailed parametric study is presented to assess the resulting drag reduction and friction factor, expressed in terms of the Poiseuille number, on the flow in microchannels. The effect of geometrical parameters is investigated for different asperity solid fraction (Φ s ), asperity height (h s ) and channel thickness (H) or tube diameter (D), while the effect of the infused fluid is studied in terms of a ratio of its viscosity relative to the viscosity of the flowing bulk fluid. Based on the results of the parametric study an extension of the conventional Moody diagram for non-wetting surfaces is developed. Finally, a design of experiments study is conducted to relate the drag reduction and Poiseuille number to the various governing parameters, using which conditions that maximize drag reduction are identified.
Differentiation of static and dynamic interfacial area in the structured packed column
Effective mass-transfer area plays a key role for post-combustion carbon capture. The static area, an inactive part relative to mass transfer, needs to be differentiated in the interfacial area. In the present study, CFD method is employed to investigate static and dynamic interfacial areas in Mellapak 500.Y structured packing. Here, a wide range of physical properties and loading conditions are included to understand their effects on both areas. The result shows that the relationship between interfacial area and interfacial velocity at the local scale can be described by gamma distribution with good accuracy. The influences of various physical properties derived from simulation are compared with existing experiment-based correlations for both static and interfacial areas. The result shows the dominant influence of viscosity on the static area, and the most importance of the influence of contact angle on the interfacial area. This study also highlights the importance of viscosity, which is usually ignored.
Localized High-Concentration Sulfone Electrolytes for High-Efficiency Lithium-Metal Batteries
To enable next-generation high-energy-density lithium (Li) metal batteries (LMBs), an electrolyte that has simultaneous high Li metal Coulombic efficiency (CE) and high anodic stability on cathodes is of significant importance. Sulfones are known for their high dielectric constants, low flammability and in particular strong resistance against oxidation, but their application in LMBs is restricted due to their poor compatibility with Li metal anode. Uncontrolled Li plating in sulfones results in poor Li CE and induces catastrophic battery failure, and their high viscosity and poor wettability towards electrodes and separators introduce serious issues for the practical applications. Here, we demonstrate that stable Li plating/stripping cycles can be achieved in concentrated sulfone-based electrolytes at a high CE over 98%, where nodule instead of dendritic Li deposition occurs. Furthermore, the viscosity and wettability issues of sulfones could be resolved by the addition of a fluorinated ether, which is a poor solvating agent for ionic species but well miscible with sulfones at microscopic scale. This localized high-concentration electrolyte (LHCE) not only provides further improvement in Li CE (to 98.8%), but also remains anodically stable with high voltage cathode and enables LMBs to operate in a wide temperature range. As a result, significantly improved cycling performance of LMBs using sulfone-based LHCE has been realized.
Data-driven variational multiscale reduced order models
We propose a new data-driven reduced order model (ROM) framework that centers around the hierarchical structure of the variational multiscale (VMS) methodology and utilizes data to increase the ROM accuracy at a modest computational cost. The VMS methodology is a natural fit for the hierarchical structure of the ROM basis: In the first step, we use the ROM projection to separate the scales into three categories: (i) resolved large scales, (ii) resolved small scales, and (iii) unresolved scales. In the second step, we explicitly identify the VMS–ROM closure terms, i.e., the terms representing the interactions among the three types of scales. In the third step, we use available data to model the VMS–ROM closure terms. Thus, instead of phenomenological models used in VMS for standard numerical discretizations (e.g., eddy viscosity models), we utilize available data to construct new structural VMS–ROM closure models. Specifically, we build ROM operators (vectors, matrices, and tensors) that are closest to the true ROM closure terms evaluated with the available data. We test the new data-driven VMS–ROM in the numerical simulation of four test cases: (i) the 1D Burgers equation with viscosity coefficient v = 10 -3 ; (ii) a 2D flow past a circular cylinder at Reynolds numbers, Re = 100, Re = 500, and Re= 1000; (iii) the quasi-geostrophic equations at Reynolds number Re = 450 and Rossby number Ro = 0.0036; and (iv) a 2D flow over a backward facing step at Reynolds number Re = 1000. The numerical results show that the data-driven VMS–ROM is significantly more accurate than standard ROMs.
Rheological and microstructural characterization of aqueous suspensions of carbon black and reduced graphene oxide
Carbon black is often used as a conductivity enhancer in battery electrodes. Reduced graphene oxide is another conducting material, with a high aspect ratio sheet-like morphology, and offers the possibility of generating a conducting network at loadings that are small compared to carbon black. Suspensions of conducting carbon, active materials and binders are typically coated on current collectors during the formation of electrodes. The rheology of these suspensions is an important indicator of the connectivity of particles in the suspension and impacts the electrical conductivity as well as the thickness of the coated layer. In this work, the rheology and microstructures of aqueous suspensions of para-aminobenzoic acid terminated carbon black (CB) with and without reduced graphene oxide (RGO) were investigated. The CB loading varied between 0.05 wt.% -10 wt.%, while the samples containing RGO had an RGO loading of 0.05 wt.%. The pH of the suspension was varied from 7.5 to 3. The carboxyl groups on the CB surface are deprotonated at pH 7.5, making the particles hydrophilic. Protonation of the carboxylate groups at pH 3 makes the particles partially hydrophobic. Suspensions of CB showed Newtonian behavior at all loadings for pH 7.5, and at loadings below 1.5 wt.% for pH 3. They are shear thinning at loadings between 1.5–10 wt.%. Interestingly, the low shear viscosity is non-monotonic with CB loading, rising up to a CB loading of 7.5 wt.%, and then dropping at 10 wt.%. Cryogenic scanning electron microscopy (SEM) showed CB particles forming aggregates at pH 3 for CB loadings greater than 1.5 wt.%. At pH 3, addition of 0.05 wt.% RGO resulted in a viscosity increase for suspensions containing 0.5 wt.% CB, as the RGO formed connections with CB particles that enhanced network formation. Adding RGO had little effect on suspensions that had 1.5 wt.% CB. The combination of SEM imaging and suspension rheology provides insight into the particle connectivity for the carbon-based materials studied here. These insights will be useful in determining coating conditions for slurries used in rechargeable battery electrodes.